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N-Benzyloxycarbonylglycyl-E-N-(4-<2-meo-carbonyl-et>-3-meo-carbonylmethylpyrrol-2-ylmethyl)-L-lysyl-L-phe benzyl ester
SpectraBase Compound ID 4s4rSruhIDK
InChI InChI=1S/C44H53N5O10/c1-56-40(51)22-21-34-26-46-38(35(34)25-41(52)57-2)27-45-23-13-12-20-36(48-39(50)28-47-44(55)59-30-33-18-10-5-11-19-33)42(53)49-37(24-31-14-6-3-7-15-31)43(54)58-29-32-16-8-4-9-17-32/h3-11,14-19,26,36-37,45-46H,12-13,20-25,27-30H2,1-2H3,(H,47,55)(H,48,50)(H,49,53)
InChIKey ARENIHCUVKJGJC-UHFFFAOYSA-N
Mol Weight 811.9 g/mol
Molecular Formula C44H53N5O10
Exact Mass 811.379243 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVpPwbBLmsp
Name N-Benzyloxycarbonylglycyl-E-N-(4-<2-meo-carbonyl-et>-3-meo-carbonylmethylpyrrol-2-ylmethyl)-L-lysyl-L-phe benzyl ester
Comments PHENYL CH PEAKS AT 127.0-129.3 PPM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C44H53N5O10
InChI InChI=1S/C44H53N5O10/c1-56-40(51)22-21-34-26-46-38(35(34)25-41(52)57-2)27-45-23-13-12-20-36(48-39(50)28-47-44(55)59-30-33-18-10-5-11-19-33)42(53)49-37(24-31-14-6-3-7-15-31)43(54)58-29-32-16-8-4-9-17-32/h3-11,14-19,26,36-37,45-46H,12-13,20-25,27-30H2,1-2H3,(H,47,55)(H,48,50)(H,49,53)
InChIKey ARENIHCUVKJGJC-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference A.D. Miller, F.J. Leeper, A.R. Battersby, J. Chem. Soc. Perkin I 1943 (1989).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3